tert-butyl N-[[2-[2,2,2-tris(fluoranyl)ethylsulfanyl]phenyl]methyl]carbamate

Systemtic Name: tert-butyl N-[[2-[2,2,2-tris(fluoranyl)ethylsulfanyl]phenyl]methyl]carbamate Openeye Name: tert-butyl N-[[2-(2,2,2-trifluoroethylsulfanyl)phenyl]methyl]carbamate CAS Name: N-[[2-(2,2,2-trifluoroethylthio)phenyl]methyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[[2-(2,2,2-trifluoroethylsulfanyl)phenyl]methyl]carbamate Traditional Name: N-[2-(2,2,2-trifluoroethylthio)benzyl]carbamic acid tert-butyl ester Formula: C14H18F3NO2S MolecularWeight: 321.35843

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCC1=CC=CC=C1SCC(F)(F)F

Isomeric SMILES

CC(C)(C)OC(=O)NCC1=CC=CC=C1SCC(F)(F)F

InChI

InChI=1S/C14H18F3NO2S/c1-13(2,3)20-12(19)18-8-10-6-4-5-7-11(10)21-9-14(15,16)17/h4-7H,8-9H2,1-3H3,(H,18,19)